CYCLOARTAN-3-OL,3-ACETOXY-24-25-EPOXY

Structure

2D structure of CYCLOARTAN-3-OL,3-ACETOXY-24-25-EPOXY
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 14484270

Names and identifiers

Name

CYCLOARTAN-3-OL,3-ACETOXY-24-25-EPOXY

IUPAC name

(2aR,3R,5aS,5bS,7aR,9S,11aR,12aS)-3-((2R)-4-(3,3-dimethyloxiran-2-yl)butan-2-yl)-2a,5a,8,8-tetramethyltetradecahydro-1H,12H-cyclopenta[a]cyclopropa[e]phenanthren-9-yl acetate

SMILES

C[C@H](CCC1C(C)(C)O1)[C@H]2CC[C@@]3([C@@]2(CC[C@]45[C@H]3CC[C@@H]6[C@]4(C5)CC[C@@H](C6(C)C)OC(=O)C)C)C

General information

Molecular formula

C32H52O3

Molecular weight

484.77 g/mol

Monoisotopic mass

484.3916 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Bryonia dioica Jacq. aerial parts -
Akihisa, T., Kimura, Y., Koike, K., Kokke, W.C.M.C., Nikaido, T., Tamura, T. (1998). Cycloartane triterpenoids from the aerial part of Bryonia dioica. Phytochemistry, 49(6), 1757-1760 doi:10.1016/s0031-9422(98)00287-8